S-phenyl 5-(2-phenylethynyl)furan-2-carbothioate

Systemtic Name: S-phenyl 5-(2-phenylethynyl)furan-2-carbothioate Openeye Name: S-phenyl 5-(2-phenylethynyl)furan-2-carbothioate CAS Name: 5-(2-phenylethynyl)-2-furancarbothioic acid S-phenyl ester IUPAC Name: S-phenyl 5-(2-phenylethynyl)furan-2-carbothioate Traditional Name: 5-(2-phenylethynyl)furan-2-carbothioic acid S-phenyl ester Formula: C19H12O2S MolecularWeight: 304.36238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC=C(O2)C(=O)SC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC=C(O2)C(=O)SC3=CC=CC=C3

InChI

InChI=1S/C19H12O2S/c20-19(22-17-9-5-2-6-10-17)18-14-13-16(21-18)12-11-15-7-3-1-4-8-15/h1-10,13-14H